diethyl 2-ethyl-2-[3-oxidanylidene-3-(1,3,4-thiadiazol-2-ylamino)propyl]propanedioate

Systemtic Name: diethyl 2-ethyl-2-[3-oxidanylidene-3-(1,3,4-thiadiazol-2-ylamino)propyl]propanedioate Openeye Name: diethyl 2-ethyl-2-[3-oxo-3-(1,3,4-thiadiazol-2-ylamino)propyl]propanedioate CAS Name: 2-ethyl-2-[3-oxo-3-(1,3,4-thiadiazol-2-ylamino)propyl]propanedioic acid diethyl ester IUPAC Name: diethyl 2-ethyl-2-[3-oxo-3-(1,3,4-thiadiazol-2-ylamino)propyl]propanedioate Traditional Name: 2-ethyl-2-[3-keto-3-(1,3,4-thiadiazol-2-ylamino)propyl]malonic acid diethyl ester Formula: C14H21N3O5S MolecularWeight: 343.39864

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CCC(=O)NC1=NN=CS1)(C(=O)OCC)C(=O)OCC

Isomeric SMILES

CCC(CCC(=O)NC1=NN=CS1)(C(=O)OCC)C(=O)OCC

InChI

InChI=1S/C14H21N3O5S/c1-4-14(11(19)21-5-2,12(20)22-6-3)8-7-10(18)16-13-17-15-9-23-13/h9H,4-8H2,1-3H3,(H,16,17,18)